1-[(E)-2-(9-butyl-3-methanoyl-pyrido[3,4-b]indol-1-yl)ethylideneamino]thiourea

Systemtic Name: 1-[(E)-2-(9-butyl-3-methanoyl-pyrido[3,4-b]indol-1-yl)ethylideneamino]thiourea Openeye Name: [(E)-2-(9-butyl-3-formyl-pyrido[3,4-b]indol-1-yl)ethylideneamino]thiourea CAS Name: [(E)-2-(9-butyl-3-formyl-1-pyrido[3,4-b]indolyl)ethylideneamino]thiourea IUPAC Name: [(E)-2-(9-butyl-3-formylpyrido[3,4-b]indol-1-yl)ethylideneamino]thiourea Traditional Name: [(E)-2-(9-butyl-3-formyl-$b-carbolin-1-yl)ethylideneamino]thiourea Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2C3=CC(=NC(=C31)CC=NNC(=S)N)C=O

Isomeric SMILES

CCCCN1C2=CC=CC=C2C3=CC(=NC(=C31)C/C=N/NC(=S)N)C=O

InChI

InChI=1S/C19H21N5OS/c1-2-3-10-24-17-7-5-4-6-14(17)15-11-13(12-25)22-16(18(15)24)8-9-21-23-19(20)26/h4-7,9,11-12H,2-3,8,10H2,1H3,(H3,20,23,26)/b21-9+