2-[(5-azanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(9-ethylcarbazol-3-yl)propanamide

Systemtic Name: 2-[(5-azanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(9-ethylcarbazol-3-yl)propanamide Openeye Name: 2-[(4-allyl-5-amino-1,2,4-triazol-3-yl)sulfanyl]-N-(9-ethylcarbazol-3-yl)propanamide CAS Name: 2-[(5-amino-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-N-(9-ethyl-3-carbazolyl)propanamide IUPAC Name: 2-[(5-amino-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-N-(9-ethylcarbazol-3-yl)propanamide Traditional Name: 2-[(4-allyl-5-amino-1,2,4-triazol-3-yl)thio]-N-(9-ethylcarbazol-3-yl)propionamide Formula: C22H24N6OS MolecularWeight: 420.53056

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)NC(=O)C(C)SC3=NN=C(N3CC=C)N)C4=CC=CC=C41

Isomeric SMILES

CCN1C2=C(C=C(C=C2)NC(=O)C(C)SC3=NN=C(N3CC=C)N)C4=CC=CC=C41

InChI

InChI=1S/C22H24N6OS/c1-4-12-28-21(23)25-26-22(28)30-14(3)20(29)24-15-10-11-19-17(13-15)16-8-6-7-9-18(16)27(19)5-2/h4,6-11,13-14H,1,5,12H2,2-3H3,(H2,23,25)(H,24,29)