1-[[1-[(2-cyanophenyl)methyl]-2-methyl-indol-3-yl]methylideneamino]-3-ethyl-thiourea

Systemtic Name: 1-[[1-[(2-cyanophenyl)methyl]-2-methyl-indol-3-yl]methylideneamino]-3-ethyl-thiourea Openeye Name: 1-[[1-[(2-cyanophenyl)methyl]-2-methyl-indol-3-yl]methyleneamino]-3-ethyl-thiourea CAS Name: 1-[[1-[(2-cyanophenyl)methyl]-2-methyl-3-indolyl]methylideneamino]-3-ethylthiourea IUPAC Name: 1-[[1-[(2-cyanophenyl)methyl]-2-methylindol-3-yl]methylideneamino]-3-ethylthiourea Traditional Name: 1-[[1-(2-cyanobenzyl)-2-methyl-indol-3-yl]methyleneamino]-3-ethyl-thiourea Formula: C21H21N5S MolecularWeight: 375.48994

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NN=CC1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3C#N)C

Isomeric SMILES

CCNC(=S)NN=CC1=C(N(C2=CC=CC=C21)CC3=CC=CC=C3C#N)C

InChI

InChI=1S/C21H21N5S/c1-3-23-21(27)25-24-13-19-15(2)26(20-11-7-6-10-18(19)20)14-17-9-5-4-8-16(17)12-22/h4-11,13H,3,14H2,1-2H3,(H2,23,25,27)