3-azanyl-N-[2-[4-(2-azanylidene-3-cyclohexyl-imidazolidin-1-yl)sulfonylphenyl]ethyl]propanamide

Systemtic Name: 3-azanyl-N-[2-[4-(2-azanylidene-3-cyclohexyl-imidazolidin-1-yl)sulfonylphenyl]ethyl]propanamide Openeye Name: 3-amino-N-[2-[4-(3-cyclohexyl-2-imino-imidazolidin-1-yl)sulfonylphenyl]ethyl]propanamide CAS Name: 3-amino-N-[2-[4-[(3-cyclohexyl-2-imino-1-imidazolidinyl)sulfonyl]phenyl]ethyl]propanamide IUPAC Name: 3-amino-N-[2-[4-(3-cyclohexyl-2-iminoimidazolidin-1-yl)sulfonylphenyl]ethyl]propanamide Traditional Name: 3-amino-N-[2-[4-(3-cyclohexyl-2-imino-imidazolidin-1-yl)sulfonylphenyl]ethyl]propionamide Formula: C20H31N5O3S MolecularWeight: 421.55684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(C2=N)S(=O)(=O)C3=CC=C(C=C3)CCNC(=O)CCN

Isomeric SMILES

C1CCC(CC1)N2CCN(C2=N)S(=O)(=O)C3=CC=C(C=C3)CCNC(=O)CCN

InChI

InChI=1S/C20H31N5O3S/c21-12-10-19(26)23-13-11-16-6-8-18(9-7-16)29(27,28)25-15-14-24(20(25)22)17-4-2-1-3-5-17/h6-9,17,22H,1-5,10-15,21H2,(H,23,26)