1-[2-[3-[(4-azanyl-1-oxidanylidene-1,2,5-thiadiazol-3-yl)amino]propoxy]pyrimidin-4-yl]-2-propyl-guanidine

Systemtic Name: 1-[2-[3-[(4-azanyl-1-oxidanylidene-1,2,5-thiadiazol-3-yl)amino]propoxy]pyrimidin-4-yl]-2-propyl-guanidine Openeye Name: 1-[2-[3-[(4-amino-1-oxo-1,2,5-thiadiazol-3-yl)amino]propoxy]pyrimidin-4-yl]-2-propyl-guanidine CAS Name: 1-[2-[3-[(4-amino-1-oxo-1,2,5-thiadiazol-3-yl)amino]propoxy]-4-pyrimidinyl]-2-propylguanidine IUPAC Name: 1-[2-[3-[(4-amino-1-oxo-1,2,5-thiadiazol-3-yl)amino]propoxy]pyrimidin-4-yl]-2-propylguanidine Traditional Name: 1-[2-[3-[(4-amino-1-keto-1,2,5-thiadiazol-3-yl)amino]propoxy]pyrimidin-4-yl]-2-propyl-guanidine Formula: C13H21N9O2S MolecularWeight: 367.42994

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Descriptors Computed from Structure

Canonical SMILES:

CCCN=C(N)NC1=NC(=NC=C1)OCCCNC2=NS(=O)N=C2N

Isomeric SMILES

CCCN=C(N)NC1=NC(=NC=C1)OCCCNC2=NS(=O)N=C2N

InChI

InChI=1S/C13H21N9O2S/c1-2-5-17-12(15)19-9-4-7-18-13(20-9)24-8-3-6-16-11-10(14)21-25(23)22-11/h4,7H,2-3,5-6,8H2,1H3,(H2,14,21)(H,16,22)(H3,15,17,18,19,20)