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4-[bis(azanyl)methylideneamino]butyl 1-azanylidene-3-undecyl-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carboxylate

4-[bis(azanyl)methylideneamino]butyl 1-azanylidene-3-undecyl-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carboxylate

Systemtic Name:4-[bis(azanyl)methylideneamino]butyl 1-azanylidene-3-undecyl-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carboxylate
Openeye Name:4-guanidinobutyl 1-imino-3-undecyl-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carboxylate
CAS Name:1-imino-3-undecyl-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carboxylic acid 4-(diaminomethylideneamino)butyl ester
IUPAC Name:4-(diaminomethylideneamino)butyl 1-imino-3-undecyl-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carboxylate
Traditional Name:1-imino-3-undecyl-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carboxylic acid 4-guanidinobutyl ester
Formula: C24H42N6O2
MolecularWeight: 446.62928
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC1=NC(=N)N2CCCC2=C1C(=O)OCCCCN=C(N)N


Isomeric SMILES

CCCCCCCCCCCC1=NC(=N)N2CCCC2=C1C(=O)OCCCCN=C(N)N


InChI

InChI=1S/C24H42N6O2/c1-2-3-4-5-6-7-8-9-10-14-19-21(20-15-13-17-30(20)24(27)29-19)22(31)32-18-12-11-16-28-23(25)26/h27H,2-18H2,1H3,(H4,25,26,28)


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