1-[[(E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoyl]amino]-3-propan-2-yl-thiourea

Systemtic Name: 1-[[(E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoyl]amino]-3-propan-2-yl-thiourea Openeye Name: 1-[[(E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)prop-2-enoyl]amino]-3-isopropyl-thiourea CAS Name: 1-[[(E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-1-oxoprop-2-enyl]amino]-3-propan-2-ylthiourea IUPAC Name: 1-[[(E)-2-cyano-3-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)prop-2-enoyl]amino]-3-propan-2-ylthiourea Traditional Name: 1-[[(E)-2-cyano-3-(1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)acryloyl]amino]-3-isopropyl-thiourea Formula: C17H23N5OS MolecularWeight: 345.46242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C=C(C#N)C(=O)NNC(=S)NC(C)C

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)/C=C(\C#N)/C(=O)NNC(=S)NC(C)C

InChI

InChI=1S/C17H23N5OS/c1-10(2)19-17(24)21-20-16(23)14(9-18)8-13-7-11(3)22(12(13)4)15-5-6-15/h7-8,10,15H,5-6H2,1-4H3,(H,20,23)(H2,19,21,24)/b14-8+