1-(2-ethoxyphenyl)-3-[(E)-(1-methyl-5-piperidin-1-ylsulfonyl-indol-3-yl)methylideneamino]thiourea

Systemtic Name: 1-(2-ethoxyphenyl)-3-[(E)-(1-methyl-5-piperidin-1-ylsulfonyl-indol-3-yl)methylideneamino]thiourea Openeye Name: 1-(2-ethoxyphenyl)-3-[(E)-[1-methyl-5-(1-piperidylsulfonyl)indol-3-yl]methyleneamino]thiourea CAS Name: 1-(2-ethoxyphenyl)-3-[(E)-[1-methyl-5-(1-piperidinylsulfonyl)-3-indolyl]methylideneamino]thiourea IUPAC Name: 1-(2-ethoxyphenyl)-3-[(E)-(1-methyl-5-piperidin-1-ylsulfonylindol-3-yl)methylideneamino]thiourea Traditional Name: 1-[(E)-(1-methyl-5-piperidinosulfonyl-indol-3-yl)methyleneamino]-3-o-phenetyl-thiourea Formula: C24H29N5O3S2 MolecularWeight: 499.64876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=S)NN=CC2=CN(C3=C2C=C(C=C3)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=S)N/N=C/C2=CN(C3=C2C=C(C=C3)S(=O)(=O)N4CCCCC4)C

InChI

InChI=1S/C24H29N5O3S2/c1-3-32-23-10-6-5-9-21(23)26-24(33)27-25-16-18-17-28(2)22-12-11-19(15-20(18)22)34(30,31)29-13-7-4-8-14-29/h5-6,9-12,15-17H,3-4,7-8,13-14H2,1-2H3,(H2,26,27,33)/b25-16+