[(2S)-2-[(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azaniumylcarbothioylamino]propyl]-dipentyl-azanium

Systemtic Name: [(2S)-2-[(4-methyl-2-oxidanyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azaniumylcarbothioylamino]propyl]-dipentyl-azanium Openeye Name: [(2S)-2-[(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)ammoniocarbothioylamino]propyl]-dipentyl-ammonium CAS Name: [(2S)-2-[[(2-hydroxy-4-methyl-5,6,8,8a-tetrahydro-1-benzopyran-7-ylidene)ammonio-sulfanylidenemethyl]amino]propyl]-dipentylammonium IUPAC Name: [(2S)-2-[(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)azaniumylcarbothioylamino]propyl]-dipentylazanium Traditional Name: diamyl-[(2S)-2-[(2-hydroxy-4-methyl-5,6,8,8a-tetrahydrochromen-7-ylidene)ammoniocarbothioylamino]propyl]ammonium Formula: C24H43N3O2S+2 MolecularWeight: 437.68212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC[NH+](CCCCC)CC(C)NC(=S)[NH+]=C1CCC2=C(C=C(OC2C1)O)C

Isomeric SMILES

CCCCC[NH+](CCCCC)C[C@H](C)NC(=S)[NH+]=C1CCC2=C(C=C(OC2C1)O)C

InChI

InChI=1S/C24H41N3O2S/c1-5-7-9-13-27(14-10-8-6-2)17-19(4)25-24(30)26-20-11-12-21-18(3)15-23(28)29-22(21)16-20/h15,19,22,28H,5-14,16-17H2,1-4H3,(H,25,30)/p+2/t19-,22?/m0/s1