3-ethyl-4-[(9-pentan-3-yl-7-thia-9-azaspiro[4.4]nonan-8-ylidene)amino]benzenecarbonitrile

Systemtic Name: 3-ethyl-4-[(9-pentan-3-yl-7-thia-9-azaspiro[4.4]nonan-8-ylidene)amino]benzenecarbonitrile Openeye Name: 3-ethyl-4-[[9-(1-ethylpropyl)-7-thia-9-azaspiro[4.4]nonan-8-ylidene]amino]benzonitrile CAS Name: 3-ethyl-4-[(9-pentan-3-yl-7-thia-9-azaspiro[4.4]nonan-8-ylidene)amino]benzonitrile IUPAC Name: 3-ethyl-4-[(9-pentan-3-yl-7-thia-9-azaspiro[4.4]nonan-8-ylidene)amino]benzonitrile Traditional Name: 3-ethyl-4-[[9-(1-ethylpropyl)-7-thia-9-azaspiro[4.4]nonan-8-ylidene]amino]benzonitrile Formula: C21H29N3S MolecularWeight: 355.54006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C#N)N=C2N(C3(CCCC3)CS2)C(CC)CC

Isomeric SMILES

CCC1=C(C=CC(=C1)C#N)N=C2N(C3(CCCC3)CS2)C(CC)CC

InChI

InChI=1S/C21H29N3S/c1-4-17-13-16(14-22)9-10-19(17)23-20-24(18(5-2)6-3)21(15-25-20)11-7-8-12-21/h9-10,13,18H,4-8,11-12,15H2,1-3H3