2-[(E)-[[5-chloranyl-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]-cyclopropyl-methylidene]amino]guanidine

Systemtic Name: 2-[(E)-[[5-chloranyl-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]-cyclopropyl-methylidene]amino]guanidine Openeye Name: 2-[(E)-[[5-chloro-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]-cyclopropyl-methylene]amino]guanidine CAS Name: 2-[(E)-[[5-chloro-1-(4-methoxyphenyl)sulfonyl-3-indolyl]-cyclopropylmethylidene]amino]guanidine IUPAC Name: 2-[(E)-[[5-chloro-1-(4-methoxyphenyl)sulfonylindol-3-yl]-cyclopropylmethylidene]amino]guanidine Traditional Name: 2-[(E)-[[5-chloro-1-(4-methoxyphenyl)sulfonyl-indol-3-yl]-cyclopropyl-methylene]amino]guanidine Formula: C20H20ClN5O3S MolecularWeight: 445.9225

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Cl)C(=NN=C(N)N)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2C=C(C3=C2C=CC(=C3)Cl)/C(=N/N=C(N)N)/C4CC4

InChI

InChI=1S/C20H20ClN5O3S/c1-29-14-5-7-15(8-6-14)30(27,28)26-11-17(16-10-13(21)4-9-18(16)26)19(12-2-3-12)24-25-20(22)23/h4-12H,2-3H2,1H3,(H4,22,23,25)/b24-19+