1-butyl-3-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methylideneamino]thiourea

Systemtic Name: 1-butyl-3-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methylideneamino]thiourea Openeye Name: 1-butyl-3-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methyleneamino]thiourea CAS Name: 1-butyl-3-[(Z)-[1-(2-cyanoethyl)-3-indolyl]methylideneamino]thiourea IUPAC Name: 1-butyl-3-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methylideneamino]thiourea Traditional Name: 1-butyl-3-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methyleneamino]thiourea Formula: C17H21N5S MolecularWeight: 327.44714

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=CC1=CN(C2=CC=CC=C21)CCC#N

Isomeric SMILES

CCCCNC(=S)N/N=C\C1=CN(C2=CC=CC=C21)CCC#N

InChI

InChI=1S/C17H21N5S/c1-2-3-10-19-17(23)21-20-12-14-13-22(11-6-9-18)16-8-5-4-7-15(14)16/h4-5,7-8,12-13H,2-3,6,10-11H2,1H3,(H2,19,21,23)/b20-12-