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

Systemtic Name: 1-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methyleneamino]thiourea CAS Name: 1-[(Z)-[1-(2-cyanoethyl)-3-indolyl]methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(Z)-[1-(2-cyanoethyl)indol-3-yl]methyleneamino]thiourea Formula: C16H17N5S MolecularWeight: 311.40468

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N5S/c1-2-9-18-16(22)20-19-11-13-12-21(10-5-8-17)15-7-4-3-6-14(13)15/h2-4,6-7,11-12H,1,5,9-10H2,(H2,18,20,22)/b19-11-